Ipconazole

125225-28-7

CAS Name

Ipconazole

Molecular Formula

C₁₈H₂₄ClN₃O

Molecular Mass

333.86

Compound Properties

• Melting Point (1)

  89 °C

Source(s)

• (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3

InChIKey

InChIKey=QTYCMDBMOLSEAM-UHFFFAOYSA-N

SMILES

C(C1(O)C(CC2=CC=C(Cl)C=C2)CCC1C(C)C)N3C=NC=N3

Canonical SMILES

ClC1=CC=C(C=C1)CC2CCC(C(C)C)C2(O)CN3N=CN=C3

Other Names for this Substance

Deleted or Replaced CAS Registry Numbers

149202-33-5, 1135441-11-0